1-triethylstannylethanone

C8H18OSn — CID 174939345

IUPAC1-triethylstannylethanone
SMILESCC[Sn](CC)(CC)C(C)=O
InChIInChI=1S/C2H3O.3C2H5.Sn/c1-2-3;3*1-2;/h1H3;3*1H2,2H3;
InChIKeyJWXRUDJMCYBTFN-UHFFFAOYSA-N
MW248.94 g/mol
LogP2.62
Rot. Bonds4

About 1-triethylstannylethanone

1-triethylstannylethanone (PubChem CID 174939345) has the molecular formula C8H18OSn and a molecular weight of 248.94 g/mol. Its IUPAC name is 1-triethylstannylethanone.

Molecular Properties

Compound Name1-triethylstannylethanone
PubChem CID174939345
Molecular FormulaC8H18OSn
Molecular Weight248.94 g/mol
Exact Mass250.04
IUPAC Name1-triethylstannylethanone
SMILESCC[Sn](CC)(CC)C(C)=O
InChIInChI=1S/C2H3O.3C2H5.Sn/c1-2-3;3*1-2;/h1H3;3*1H2,2H3;
InChIKeyJWXRUDJMCYBTFN-UHFFFAOYSA-N
XLogP2.62
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.94
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

propane;propan-2-one
CID 90822370
triethylstannyl acetate
CID 16682966
ethanol;propan-2-one;1,1,1,2-tetrafluoroethane
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bis(butan-2-one);methane
CID 160665705
3-iminopentane-2,4-dione
CID 22149455
acetic acid;azane;propane
CID 173127482
butan-2-one;ethane
CID 158905935
bis(cobalt(2+));propanoate;diacetate
CID 173406713
butan-2-one;oxotin
CID 57474512
butan-2-one;methane;propan-2-one
CID 157260382
antimony(3+);propanoate;diacetate
CID 23464193
3-deuteriobutan-2-one
CID 159540848

Frequently Asked Questions

What is the IUPAC name of 1-triethylstannylethanone?
The IUPAC name of 1-triethylstannylethanone (CID 174939345) is 1-triethylstannylethanone.
What is the SMILES notation for 1-triethylstannylethanone?
The canonical SMILES for 1-triethylstannylethanone is CC[Sn](CC)(CC)C(C)=O.
What is the InChIKey of 1-triethylstannylethanone?
The InChIKey is JWXRUDJMCYBTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3O.3C2H5.Sn/c1-2-3;3*1-2;/h1H3;3*1H2,2H3;.
What are the key properties of 1-triethylstannylethanone?
1-triethylstannylethanone has a molecular weight of 248.94 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-triethylstannylethanone is sourced from PubChem (CID 174939345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).